@prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
@prefix skos: <http://www.w3.org/2004/02/skos/core#> .
@prefix ns0: <http://rdf-vocabulary.ddialliance.org/xkos#> .

<http://rdf-vocabulary.ddialliance.org/xkos#monoisotopicmass> rdfs:label "جرم تک‌ایزوتوپی"@fa, "monoisotopicmass"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:188705>
  skos:broader <http://www.irandoc.acir/onto/irandoc/CHEBI:22475> ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:prefLabel "لینگبیاتوکسین C"@fa, "lyngbyatoxin c"@en ;
  ns0:smiles "O=C1N[C@@H](CC=2C=3C(NC2)=C([C@@](C/C=C/C(O)(C)C)(C)C=C)C=CC3N([C@H]1C(C)C)C)CO" ;
  ns0:formula "C27H39N3O3" ;
  ns0:monoisotopicmass "453.29914" ;
  ns0:synonym_EXACT "lyngbyatoxin C", "(10S,13S)-5-[(3R,5E)-7-hydroxy-3,7-dimethylocta-1,5-dien-3-yl]-13-(hydroxymethyl)-9-methyl-10-propan-2-yl-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-1,4,6,8(15)-tetraen-11-one" ;
  ns0:charge "0" ;
  ns0:subset "2_STAR" ;
  ns0:inchikey "VMLLPMJDAXPWAA-PIKNDIPASA-N" ;
  ns0:inchi "InChI=1S/C27H39N3O3/c1-8-27(6,13-9-12-26(4,5)33)20-10-11-21-22-18(15-28-23(20)22)14-19(16-31)29-25(32)24(17(2)3)30(21)7/h8-12,15,17,19,24,28,31,33H,1,13-14,16H2,2-7H3,(H,29,32)/b12-9+/t19-,24-,27-/m0/s1" ;
  ns0:mass "453.627" .

ns0:formula rdfs:label "فرمول"@fa, "formula"@en .
ns0:smiles rdfs:label "اسمایلٓ"@fa, "smiles"@en .
ns0:subset rdfs:label "زیرمجموعه"@fa, "subset"@en .
<http://www.irandoc.acir/onto/irandoc/CHEBI:22475>
  skos:prefLabel "آمینو اسید آمید"@fa, "amino acid amide"@en ;
  a <http://www.irandoc.ac.ir/onto/irandoc-meta/Concept>, skos:Concept ;
  skos:narrower <http://www.irandoc.acir/onto/irandoc/CHEBI:188705> .

ns0:inchikey rdfs:label "اینچی‌کی"@fa, "inchikey"@en .
ns0:charge rdfs:label "charge"@en, "بار"@fa .
ns0:inchi rdfs:label "اینچی"@fa, "inchi"@en .
ns0:synonym_EXACT rdfs:label "مترادف دقیق"@fa, "synonym EXACT"@en .
ns0:mass rdfs:label "جرم"@fa, "mass"@en .
